5-Dehydro Tolvaptan

CAS: 137973-76-3

Ref. TR-D230350

Product Information

• Name: 5-Dehydro Tolvaptan
• Synonyms: N-[4-[(7-Chloro-2,3,4,5-tetrahydro-5-oxo-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide, 1H-1-Benzazepine, Benzamide Deriv., 7-Chloro-1-[2-methyl-4-[(2-methylbenzoyl)amino]benzoyl]-5-Oxo-2,3,4,5-tetrahydro-1H-1-benzazepine, N-​ [4-​ [(7-​ Chloro-​ 2,​ 3,​ 4,​ 5-​ tetrahydro-​ 5-​ oxo-​ 1H-​ 1-​ benzazepin-​ 1-​ yl)​ carbonyl]​ -​ 3-​ methylphenyl]​ -​ 2-​ methylbenzamide

Description

Applications 5-Dehydro Tolvaptan is an impurity of Tolvaptan (T536650), a selective, competitive arginine vasopressin V2 receptor antagonist used to treat hyponatremia (low blood sodium levels) associated with congestive heart failure, cirrhosis, and the syndrome of inappropriate antidiuretic hormone (SIADH g
References Yin, L., et al.: Tetrahedron, Asym., 21, 2390 (2010); Torisawa, Y., et al.: Bioorg. Med. Chem. Lett., 17, 6455 (2007); Kondo, K., et al.: Bioorg. Med. Chem., 7, 1743 (1999);

• Brand: TRC

Chemical properties

• Molecular weight: 446.93
• Formula: C₂₆H₂₃ClN₂O₃
• Color/Form: Neat
• InChI: InChI=1S/C26H23ClN2O3/c1-16-6-3-4-7-20(16)25(31)28-19-10-11-21(17(2)14-19)26(32)29-13-5-8-24(30)22-15-18(27)9-12-23(22)29/h3-4,6-7,9-12,14-15H,5,8,13H2,1-2H3,(H,28,31)
• InChI key: InChIKey=VENGMROMZOKURN-UHFFFAOYSA-N
• SMILES: Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(=O)c3cc(Cl)ccc32)c(C)c1